SpectraBase Spectrum ID |
HqbFGYwzOdf |
Name |
Ethyl 1-benzyl-3-methyl-4-methylene-2-oxopyrrolidine-3-carboxylate |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
273.136493473 u |
Formula |
C16H19NO3 |
InChI |
InChI=1S/C16H19NO3/c1-4-20-15(19)16(3)12(2)10-17(14(16)18)11-13-8-6-5-7-9-13/h5-9H,2,4,10-11H2,1,3H3 |
InChIKey |
GQKFHLOHGHJAAY-UHFFFAOYSA-N |
SMILES |
C1(N(CC(C1(C(=O)OCC)C)=C)CC=1C=CC=CC1)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.976491 |